Triethyl 2,2',2''-(1,4,7,10-tetraazacyclododecane-1,4,7-triyl)triacetate

Catalog Number	ACM114873528-1
CAS	114873-52-8
Structure
Synonyms	1,4,7-Tris(ethoxycarbonylmethyl)-1,4,7,10-tetraazacyclododecane; Ethyl 2-[4,7-bis(2-ethoxy-2-oxoethyl)-1,4,7,10-tetrazacyclododec-1-yl]acetate
IUPAC Name	ethyl 2-[4,7-bis(2-ethoxy-2-oxoethyl)-1,4,7,10-tetrazacyclododec-1-yl]acetate
Molecular Weight	430.54
Molecular Formula	C20H38N4O6
InChI	BPEUICGMDOXPJJ-UHFFFAOYSA-N
InChI Key	InChI=1S/C20H38N4O6/c1-4-28-18(25)15-22-9-7-21-8-10-23(16-19(26)29-5-2)12-14-24(13-11-22)17-20(27)30-6-3/h21H,4-17H2,1-3H3
Boiling Point	514.8±50.0 °C(Predicted)
Purity	98%
Isomeric SMILES	CCOC(=O)CN1CCNCCN(CCN(CC1)CC(=O)OCC)CC(=O)OCC

Q&A

What is the CAS number for Triethyl 2,2',2''-(1,4,7,10-tetraazacyclododecane-1,4,7-triyl)triacetate?

The CAS number for Triethyl 2,2',2''-(1,4,7,10-tetraazacyclododecane-1,4,7-triyl)triacetate is 114873-52-8.

What is the molecular weight of Triethyl 2,2',2''-(1,4,7,10-tetraazacyclododecane-1,4,7-triyl)triacetate?

The molecular weight of Triethyl 2,2',2''-(1,4,7,10-tetraazacyclododecane-1,4,7-triyl)triacetate is 430.54.

What are some synonyms for Triethyl 2,2',2''-(1,4,7,10-tetraazacyclododecane-1,4,7-triyl)triacetate?

Some synonyms for Triethyl 2,2',2''-(1,4,7,10-tetraazacyclododecane-1,4,7-triyl)triacetate include 1,4,7-Tris(ethoxycarbonylmethyl)-1,4,7,10-tetraazacyclododecane and DO3A-t-Ethyl ester.

What is the molecular formula of Triethyl 2,2',2''-(1,4,7,10-tetraazacyclododecane-1,4,7-triyl)triacetate?

The molecular formula of Triethyl 2,2',2''-(1,4,7,10-tetraazacyclododecane-1,4,7-triyl)triacetate is C20H38N4O6.

What is the predicted boiling point of Triethyl 2,2',2''-(1,4,7,10-tetraazacyclododecane-1,4,7-triyl)triacetate?

The predicted boiling point of Triethyl 2,2',2''-(1,4,7,10-tetraazacyclododecane-1,4,7-triyl)triacetate is 514.8±50.0 °C.

How should Triethyl 2,2',2''-(1,4,7,10-tetraazacyclododecane-1,4,7-triyl)triacetate be stored?

Triethyl 2,2',2''-(1,4,7,10-tetraazacyclododecane-1,4,7-triyl)triacetate should be stored under inert gas (nitrogen or Argon) at 2-8°C.

What is the density of Triethyl 2,2',2''-(1,4,7,10-tetraazacyclododecane-1,4,7-triyl)triacetate?

The density of Triethyl 2,2',2''-(1,4,7,10-tetraazacyclododecane-1,4,7-triyl)triacetate is 1.064.

What is the predicted pKa value of Triethyl 2,2',2''-(1,4,7,10-tetraazacyclododecane-1,4,7-triyl)triacetate?

The predicted pKa value of Triethyl 2,2',2''-(1,4,7,10-tetraazacyclododecane-1,4,7-triyl)triacetate is 9.59±0.20.

What is the storage temperature recommended for Triethyl 2,2',2''-(1,4,7,10-tetraazacyclododecane-1,4,7-triyl)triacetate?

The recommended storage temperature for Triethyl 2,2',2''-(1,4,7,10-tetraazacyclododecane-1,4,7-triyl)triacetate is 2-8°C.

What is one of the potential applications of Triethyl 2,2',2''-(1,4,7,10-tetraazacyclododecane-1,4,7-triyl)triacetate?

One potential application of Triethyl 2,2',2''-(1,4,7,10-tetraazacyclododecane-1,4,7-triyl)triacetate is as an impurity in Gadoteridol, a contrast agent used in magnetic resonance imaging.